(Q83124993)

English

2(1H)-pyrimidinone, 4-amino-3,4-dihydro-5-iodo-1-((6R,7R)-tetrahydro-2,7-dihydroxy-2-oxido-4H-furo(3,2-d)-1,3,2-dioxaphosphorin-6-yl)-, ion(1-)

chemical compound

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Statements

group of stereoisomers

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chemical compound

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429.93065786991 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₉H₁₀IN₃O₇P⁻

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based on heuristic

inferred from SMILES

canonical SMILES

N=c1nc([O-])n(C2OC3COP(=O)(O)OC3C2O)cc1I

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

N=c1nc([O-])n([C@@H]2OC3COP(=O)(O)OC3[C@H]2O)cc1I

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based on heuristic

inferred from InChI

Identifiers

InChI=1S/C9H11IN3O7P/c10-3-1-13(9(15)12-7(3)11)8-5(14)6-4(19-8)2-18-21(16,17)20-6/h1,4-6,8,14H,2H2,(H,16,17)(H2,11,12,15)/p-1/t4?,5-,6?,8-/m1/s1

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NQRQITRTZJBAOM-DVMOCUDESA-M

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CAS Registry Number

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26 December 2021

UniChem compound ID

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DSSTox substance ID

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DSSTOX compound identifier

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